SCHEMBL11577351

SCHEMBL11577351

CC(C)(C)c1c(O)ccc(CCCc2ccccc2)c1C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.45
ALOX15 P16050 1/20 0.45
BID P55957 1/20 0.41
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
BAK1 Q16611 1/20 0.41
HDAC1 Q13547 5/20 0.41
HDAC8 Q9BY41 4/20 0.41
HDAC3 O15379 3/20 0.41
HDAC2 Q92769 3/20 0.41
HDAC6 Q9UBN7 3/20 0.41
HDAC5 Q9UQL6 3/20 0.41
HDAC4 P56524 2/20 0.41
HDAC7 Q8WUI4 2/20 0.41
HDAC10 Q969S8 2/20 0.41
HDAC11 Q96DB2 2/20 0.41
HDAC9 Q9UKV0 2/20 0.41
MAPK1 P28482 1/20 0.41
ADRA1A P35348 1/20 0.41
SLC6A3 Q01959 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2799335 0.81 BCL2 (0.50) ALOX15BCL2L1
SCHEMBL9074096 0.80 TYR (0.50) ALOX15MAPK1ESR1ESR2NPC1
SCHEMBL11577538 0.78 HDAC1 (0.39) IGF1RALOX15BIDBCL2L1MCL1
SCHEMBL28035798 0.78 TYR (0.34) ALOX15TDP1
SCHEMBL28064783 0.78 TYR (0.34) ALOX15CASP3RAB9ASENP8SENP7
SCHEMBL11577298 0.77 MEN1 (0.40) IGF1RALOX15BIDBCL2L1MCL1
SCHEMBL27880027 0.77 TYR (0.56) ALOX15BIDBCL2L1MCL1BAK1
SCHEMBL11495521 0.77 TYR (0.56) ALOX15BIDBCL2L1MCL1BAK1
SCHEMBL816624 0.77 TYR (0.56) ALOX15BIDBCL2L1MCL1BAK1
SCHEMBL11578967 0.76 CYP2D6 (0.57) IGF1RALOX15BIDBCL2L1MCL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4082814-A DI-TERT-BUTYL-CINNAMYL PHENOLS, DI-TERT-BUTYL-DIHYDROCINNAMYL PHENONLS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1978-04-04 US disclosed
US-3973040-A Certain cinnamyl phenols as growth inhibitors for mosquito larvae THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1976-08-03 US disclosed